4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol
TL;DR: 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol (CAS 738-44-3) is a chemical compound with molecular formula C16H16I2O3 and molecular weight 509.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-hydroxyethyl)-2,6-diiodophenoxy]-2,6-dimethylphenol
Also Known As: 4-(4-HYDROXY-3,5-XYLYLOXY)-3,5-DIIODOPHENETHYL ALCOHOL, Benzeneethanol, 4-(4-hydroxy-3,5-dimethylphenoxy)-3,5-diiodo-, 4-[4-(2-hydroxyethyl)-2,6-diiodophenoxy]-2,6-dimethylphenol, Phenethyl alcohol, 4-((4-hydroxy-3,5-xylyl)oxy)-3,5-diiodo-
| Molecular Formula | C16H16I2O3 |
|---|---|
| Molecular Weight | 509.92 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 509.91888 |
| Heavy Atoms | 21 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 738-44-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C)OC2=C(C=C(C=C2I)CCO)I |
| InChIKey | HCMDSBFDUIXNIL-UHFFFAOYSA-N |
Product Overview
4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol (CAS 738-44-3), with molecular formula C16H16I2O3 and molecular weight 509.92 g/mol. IUPAC: 4-[4-(2-hydroxyethyl)-2,6-diiodophenoxy]-2,6-dimethylphenol.
Chemical Property Profile of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol
Property Insights of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol
The XLogP value of 4.7 indicates that 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol?
The CAS number of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol is 738-44-3.
What is the molecular formula of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol?
The molecular formula of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol is C16H16I2O3.
What is the molecular weight of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol?
The molecular weight of 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol is 509.92 g/mol.
Where can I buy 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol?
You can request a quote for 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Hydroxy-3,5-xylyloxy)-3,5-diiodophenethyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.